3,3-difluoro-2,4-dimethylhexane

C8H16F2 — CID 20576358

IUPAC3,3-difluoro-2,4-dimethylhexane
SMILESCCC(C)C(F)(F)C(C)C
InChIInChI=1S/C8H16F2/c1-5-7(4)8(9,10)6(2)3/h6-7H,5H2,1-4H3
InChIKeyGLRIXARMHIEWSM-UHFFFAOYSA-N
MW150.21 g/mol
LogP3.32
Rot. Bonds3

About 3,3-difluoro-2,4-dimethylhexane

3,3-difluoro-2,4-dimethylhexane (PubChem CID 20576358) has the molecular formula C8H16F2 and a molecular weight of 150.21 g/mol. Its IUPAC name is 3,3-difluoro-2,4-dimethylhexane.

Molecular Properties

Compound Name3,3-difluoro-2,4-dimethylhexane
PubChem CID20576358
Molecular FormulaC8H16F2
Molecular Weight150.21 g/mol
Exact Mass150.12
IUPAC Name3,3-difluoro-2,4-dimethylhexane
SMILESCCC(C)C(F)(F)C(C)C
InChIInChI=1S/C8H16F2/c1-5-7(4)8(9,10)6(2)3/h6-7H,5H2,1-4H3
InChIKeyGLRIXARMHIEWSM-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.21
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1,1-Trifluoro-2-methylhexane
CID 21020573
2-Fluoro-2,5-dimethylhexane
CID 59771333
3-(Fluoromethyl)heptane
CID 13022399
4-(Difluoromethyl)octane
CID 14909954
3-(Difluoromethyl)heptane
CID 23237105
Hexane, 1,1,1,2,3,3-hexafluoro-4-methyl-
CID 10798392
1,1,1-Trifluoro-4,8-dimethylnonane
CID 11063709
2-(Difluoromethyl)-1,1,1,2,6,6,6-heptafluoro-5-methylhexane
CID 13047336
1,1,1,2,3,3,7,7,7-Nonafluoro-4-methylheptane
CID 13047343
1,1,1-Trifluoro-3-(trifluoromethyl)heptane
CID 23236454
1,1-Difluoro-4,8-dimethylnonane
CID 86217087
5-(Trifluoromethyl)nonane
CID 12519455

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-2,4-dimethylhexane?
The IUPAC name of 3,3-difluoro-2,4-dimethylhexane (CID 20576358) is 3,3-difluoro-2,4-dimethylhexane.
What is the SMILES notation for 3,3-difluoro-2,4-dimethylhexane?
The canonical SMILES for 3,3-difluoro-2,4-dimethylhexane is CCC(C)C(F)(F)C(C)C.
What is the InChIKey of 3,3-difluoro-2,4-dimethylhexane?
The InChIKey is GLRIXARMHIEWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2/c1-5-7(4)8(9,10)6(2)3/h6-7H,5H2,1-4H3.
What are the key properties of 3,3-difluoro-2,4-dimethylhexane?
3,3-difluoro-2,4-dimethylhexane has a molecular weight of 150.21 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-2,4-dimethylhexane is sourced from PubChem (CID 20576358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).